SCHEMBL30726003

SCHEMBL30726003

NC(=O)N1CCC(c2cc[nH]n2)C1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 5/20 0.43
KDM5A P29375 9/20 0.38
SCD O00767 1/20 0.36
HSD11B1 P28845 3/20 0.35
PARP1 P09874 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18866160 0.87 RAB9A (0.38) KDM5A
SCHEMBL21391903 0.80 ALDH1A1 (0.38)
SCHEMBL2282267 0.80 HTT (0.50) PDE4B
SCHEMBL27148523 0.76 MGLL (0.33)
SCHEMBL29774649 0.75 NAMPT (0.40) KDM5AHSD11B1
SCHEMBL29640084 0.73 HSD11B1 (0.59) KDM5AHSD11B1
SCHEMBL3861940 0.73 HTT (0.55)
SCHEMBL17896811 0.73 KDM4E (0.41)
SCHEMBL2731598 0.73 JAK2 (0.52) PDE4BPARP1
SCHEMBL15516352 0.73 SLC18A3 (0.41) PARP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12552767-B2 3-heteroaryl pyrrolidine and piperidine orexin receptor agonists MERCK SHARP & DOHME LLC (US) 2026-02-17 US disclosed
US-20240002359-A1 3-HETEROARYL PYRROLIDINE AND PIPERIDINE OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME LLC (US) 2024-01-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12552767-B2 3-heteroaryl pyrrolidine and piperidine orexin receptor agonists HCRTR2, HCRTR1, NPY1R PDE4B 2010/4885KDM5A 1527/4885SCD 3787/4885
US-20240002359-A1 3-HETEROARYL PYRROLIDINE AND PIPERIDINE OREXIN RECEPTOR AGONISTS HCRTR2, HCRTR1, OXTR PDE4B 1217/4885KDM5A 1036/4885SCD 3487/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.